SCHEMBL11248152

SCHEMBL11248152

CCCCO[Si](OCCCC)(OCCCC)C(C)CN

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37
DNM1 Q05193 1/20 0.36
HTT P42858 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
OPRM1 P35372 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27474058 0.86 HTT (0.31) DNM1HTT
SCHEMBL429530 0.82 ADRB2 (0.35) ADRB2ADRB1ADRB3ALDH1A1
SCHEMBL12744368 0.81 ADRB2 (0.36) ADRB2ADRB1ADRB3DNM1HTT
SCHEMBL12190498 0.81 ADRB2 (0.36) ADRB2ADRB1ADRB3DNM1HTT
SCHEMBL2398595 0.80 ADRB2 (0.33) ADRB2ADRB1ADRB3OPRM1
SCHEMBL1964612 0.77 ADRB2 (0.40) ADRB2ADRB1ADRB3DNM1ALDH1A1
SCHEMBL427287 0.77 ADRB2 (0.38) ADRB2ADRB1ADRB3ALDH1A1CA1
SCHEMBL15333172 0.77 ADRB2 (0.38) ADRB2ADRB1ADRB3ALDH1A1CA1
SCHEMBL127240 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL15333864 0.73 ADRB2 (0.35) ADRB2ADRB1ADRB3ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4317123-A Thermal recording material FUJI PHOTO FILM CO., LTD. (JP) 1982-02-23 US claimed